B68WNO -OEChem-04022118103D 40 45 0 0 0 0 0 0 0999 V2000 2.3195 2.6316 0.4005 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.3194 2.6318 0.3992 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0003 4.7921 -1.7151 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3909 -2.7592 -0.1599 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3912 -2.7590 -0.1603 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0001 3.0080 0.4395 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0003 4.3632 0.5800 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3418 -0.3264 0.0932 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3418 -0.3263 0.0932 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6999 -1.6032 -0.0396 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7000 -1.6031 -0.0396 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6966 0.9005 0.2209 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6966 0.9006 0.2208 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7096 -0.8625 0.0371 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7098 -0.8623 0.0373 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6952 -2.2903 -0.1113 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6954 -2.2900 -0.1113 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1594 2.2741 0.3635 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1591 2.2743 0.3634 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9762 -0.2330 0.1021 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9762 -0.2328 0.1027 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8808 -3.0370 -0.1891 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8811 -3.0366 -0.1895 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1521 -0.9870 0.0234 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1522 -0.9867 0.0238 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1029 -2.3674 -0.1199 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1032 -2.3669 -0.1200 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0004 5.1533 -0.5449 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0489 -3.7062 -0.2584 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0492 -3.7060 -0.2590 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0553 0.8435 0.2140 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0554 0.8437 0.2147 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8528 -4.1168 -0.3013 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8531 -4.1164 -0.3021 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1143 -0.4843 0.0753 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.1144 -0.4839 0.0761 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0279 -2.9352 -0.1792 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0280 -2.9347 -0.1793 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0003 4.7343 1.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0005 6.2204 -0.2684 H 0 0 0 0 0 0 0 0 0 0 0 0 1 18 2 0 0 0 0 2 19 2 0 0 0 0 3 28 2 0 0 0 0 4 10 1 0 0 0 0 4 16 1 0 0 0 0 4 29 1 0 0 0 0 5 11 1 0 0 0 0 5 17 1 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 6 18 1 0 0 0 0 6 19 1 0 0 0 0 7 28 1 0 0 0 0 7 39 1 0 0 0 0 8 10 1 0 0 0 0 8 12 2 0 0 0 0 8 14 1 0 0 0 0 9 11 1 0 0 0 0 9 13 2 0 0 0 0 9 15 1 0 0 0 0 10 11 2 0 0 0 0 12 13 1 0 0 0 0 12 18 1 0 0 0 0 13 19 1 0 0 0 0 14 16 1 0 0 0 0 14 20 2 0 0 0 0 15 17 1 0 0 0 0 15 21 2 0 0 0 0 16 22 2 0 0 0 0 17 23 2 0 0 0 0 20 24 1 0 0 0 0 20 31 1 0 0 0 0 21 25 1 0 0 0 0 21 32 1 0 0 0 0 22 26 1 0 0 0 0 22 33 1 0 0 0 0 23 27 1 0 0 0 0 23 34 1 0 0 0 0 24 26 2 0 0 0 0 24 35 1 0 0 0 0 25 27 2 0 0 0 0 25 36 1 0 0 0 0 26 37 1 0 0 0 0 27 38 1 0 0 0 0 28 40 1 0 0 0 0 M END $$$$